snapshot$Compounds[[1]]
[[1]]$Name
[1] "Rifampicin"
[[1]]$IsSmallMolecule
[1] TRUE
[[1]]$PlasmaProteinBindingPartner
[1] "Albumin"
[[1]]$Lipophilicity
[[1]]$Lipophilicity[[1]]
[[1]]$Lipophilicity[[1]]$Name
[1] "Optimized"
[[1]]$Lipophilicity[[1]]$Parameters
[[1]]$Lipophilicity[[1]]$Parameters[[1]]
[[1]]$Lipophilicity[[1]]$Parameters[[1]]$Name
[1] "Lipophilicity"
[[1]]$Lipophilicity[[1]]$Parameters[[1]]$Value
[1] 2.5
[[1]]$Lipophilicity[[1]]$Parameters[[1]]$Unit
[1] "Log Units"
[[1]]$Lipophilicity[[1]]$Parameters[[1]]$ValueOrigin
[[1]]$Lipophilicity[[1]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Lipophilicity[[1]]$Parameters[[1]]$ValueOrigin$Method
[1] "ParameterIdentification"
[[1]]$Lipophilicity[[1]]$Parameters[[1]]$ValueOrigin$Description
[1] "Hanke et al. 2018"
[[1]]$FractionUnbound
[[1]]$FractionUnbound[[1]]
[[1]]$FractionUnbound[[1]]$Name
[1] "Templeton 2011"
[[1]]$FractionUnbound[[1]]$Species
[1] "Human"
[[1]]$FractionUnbound[[1]]$Parameters
[[1]]$FractionUnbound[[1]]$Parameters[[1]]
[[1]]$FractionUnbound[[1]]$Parameters[[1]]$Name
[1] "Fraction unbound (plasma, reference value)"
[[1]]$FractionUnbound[[1]]$Parameters[[1]]$Value
[1] 17
[[1]]$FractionUnbound[[1]]$Parameters[[1]]$Unit
[1] "%"
[[1]]$FractionUnbound[[1]]$Parameters[[1]]$ValueOrigin
[[1]]$FractionUnbound[[1]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$FractionUnbound[[1]]$Parameters[[1]]$ValueOrigin$Method
[1] "InVitro"
[[1]]$FractionUnbound[[1]]$Parameters[[1]]$ValueOrigin$Description
[1] "Templeton 2011 (equilibrium dialysis)"
[[1]]$Solubility
[[1]]$Solubility[[1]]
[[1]]$Solubility[[1]]$Name
[1] "Aqueous solubility"
[[1]]$Solubility[[1]]$Parameters
[[1]]$Solubility[[1]]$Parameters[[1]]
[[1]]$Solubility[[1]]$Parameters[[1]]$Name
[1] "Solubility at reference pH"
[[1]]$Solubility[[1]]$Parameters[[1]]$Value
[1] 2800
[[1]]$Solubility[[1]]$Parameters[[1]]$Unit
[1] "mg/l"
[[1]]$Solubility[[1]]$Parameters[[1]]$ValueOrigin
[[1]]$Solubility[[1]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Solubility[[1]]$Parameters[[1]]$ValueOrigin$Description
[1] "Boman 1974"
[[1]]$Solubility[[1]]$Parameters[[2]]
[[1]]$Solubility[[1]]$Parameters[[2]]$Name
[1] "Reference pH"
[[1]]$Solubility[[1]]$Parameters[[2]]$Value
[1] 7.5
[[1]]$Solubility[[1]]$Parameters[[2]]$ValueOrigin
[[1]]$Solubility[[1]]$Parameters[[2]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Solubility[[1]]$Parameters[[2]]$ValueOrigin$Description
[1] "Boman 1974"
[[1]]$IntestinalPermeability
[[1]]$IntestinalPermeability[[1]]
[[1]]$IntestinalPermeability[[1]]$Name
[1] "Optimized"
[[1]]$IntestinalPermeability[[1]]$Parameters
[[1]]$IntestinalPermeability[[1]]$Parameters[[1]]
[[1]]$IntestinalPermeability[[1]]$Parameters[[1]]$Name
[1] "Specific intestinal permeability (transcellular)"
[[1]]$IntestinalPermeability[[1]]$Parameters[[1]]$Value
[1] 1.24e-05
[[1]]$IntestinalPermeability[[1]]$Parameters[[1]]$Unit
[1] "cm/min"
[[1]]$IntestinalPermeability[[1]]$Parameters[[1]]$ValueOrigin
[[1]]$IntestinalPermeability[[1]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$IntestinalPermeability[[1]]$Parameters[[1]]$ValueOrigin$Method
[1] "ParameterIdentification"
[[1]]$IntestinalPermeability[[1]]$Parameters[[1]]$ValueOrigin$Description
[1] "Hanke et al. 2018"
[[1]]$PkaTypes
[[1]]$PkaTypes[[1]]
[[1]]$PkaTypes[[1]]$Type
[1] "Base"
[[1]]$PkaTypes[[1]]$Pka
[1] 7.9
[[1]]$PkaTypes[[1]]$ValueOrigin
[[1]]$PkaTypes[[1]]$ValueOrigin$Source
[1] "Database"
[[1]]$PkaTypes[[1]]$ValueOrigin$Description
[1] "DrugBank DB01045"
[[1]]$PkaTypes[[2]]
[[1]]$PkaTypes[[2]]$Type
[1] "Acid"
[[1]]$PkaTypes[[2]]$Pka
[1] 1.7
[[1]]$PkaTypes[[2]]$ValueOrigin
[[1]]$PkaTypes[[2]]$ValueOrigin$Source
[1] "Database"
[[1]]$PkaTypes[[2]]$ValueOrigin$Description
[1] "DrugBank DB01045"
[[1]]$Processes
[[1]]$Processes[[1]]
[[1]]$Processes[[1]]$InternalName
[1] "MetabolizationSpecific_MM"
[[1]]$Processes[[1]]$DataSource
[1] "Nakajima 2011"
[[1]]$Processes[[1]]$Molecule
[1] "AADAC"
[[1]]$Processes[[1]]$Parameters
[[1]]$Processes[[1]]$Parameters[[1]]
[[1]]$Processes[[1]]$Parameters[[1]]$Name
[1] "Enzyme concentration"
[[1]]$Processes[[1]]$Parameters[[1]]$Value
[1] 1
[[1]]$Processes[[1]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[1]]$Parameters[[2]]
[[1]]$Processes[[1]]$Parameters[[2]]$Name
[1] "Vmax"
[[1]]$Processes[[1]]$Parameters[[2]]$Value
[1] 6.5
[[1]]$Processes[[1]]$Parameters[[2]]$Unit
[1] "µmol/l/min"
[[1]]$Processes[[1]]$Parameters[[3]]
[[1]]$Processes[[1]]$Parameters[[3]]$Name
[1] "Km"
[[1]]$Processes[[1]]$Parameters[[3]]$Value
[1] 195.1
[[1]]$Processes[[1]]$Parameters[[3]]$Unit
[1] "µmol/l"
[[1]]$Processes[[1]]$Parameters[[4]]
[[1]]$Processes[[1]]$Parameters[[4]]$Name
[1] "kcat"
[[1]]$Processes[[1]]$Parameters[[4]]$Value
[1] 9.865
[[1]]$Processes[[1]]$Parameters[[4]]$Unit
[1] "1/min"
[[1]]$Processes[[1]]$Parameters[[4]]$ValueOrigin
[[1]]$Processes[[1]]$Parameters[[4]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[1]]$Parameters[[4]]$ValueOrigin$Method
[1] "ParameterIdentification"
[[1]]$Processes[[1]]$Parameters[[4]]$ValueOrigin$Description
[1] "Hanke et al. 2018"
[[1]]$Processes[[2]]
[[1]]$Processes[[2]]$InternalName
[1] "ActiveTransportSpecific_MM"
[[1]]$Processes[[2]]$DataSource
[1] "Collett 2004"
[[1]]$Processes[[2]]$Molecule
[1] "P-gp"
[[1]]$Processes[[2]]$Parameters
[[1]]$Processes[[2]]$Parameters[[1]]
[[1]]$Processes[[2]]$Parameters[[1]]$Name
[1] "Transporter concentration"
[[1]]$Processes[[2]]$Parameters[[1]]$Value
[1] 60
[[1]]$Processes[[2]]$Parameters[[1]]$Unit
[1] "nmol/l"
[[1]]$Processes[[2]]$Parameters[[2]]
[[1]]$Processes[[2]]$Parameters[[2]]$Name
[1] "Vmax"
[[1]]$Processes[[2]]$Parameters[[2]]$Value
[1] 2.87
[[1]]$Processes[[2]]$Parameters[[2]]$Unit
[1] "µmol/l/min"
[[1]]$Processes[[2]]$Parameters[[3]]
[[1]]$Processes[[2]]$Parameters[[3]]$Name
[1] "Km"
[[1]]$Processes[[2]]$Parameters[[3]]$Value
[1] 55
[[1]]$Processes[[2]]$Parameters[[3]]$Unit
[1] "µmol/l"
[[1]]$Processes[[2]]$Parameters[[4]]
[[1]]$Processes[[2]]$Parameters[[4]]$Name
[1] "kcat"
[[1]]$Processes[[2]]$Parameters[[4]]$Value
[1] 0.6088
[[1]]$Processes[[2]]$Parameters[[4]]$Unit
[1] "1/min"
[[1]]$Processes[[2]]$Parameters[[4]]$ValueOrigin
[[1]]$Processes[[2]]$Parameters[[4]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[2]]$Parameters[[4]]$ValueOrigin$Method
[1] "ParameterIdentification"
[[1]]$Processes[[2]]$Parameters[[4]]$ValueOrigin$Description
[1] "Hanke et al. 2018"
[[1]]$Processes[[3]]
[[1]]$Processes[[3]]$InternalName
[1] "ActiveTransportSpecific_MM"
[[1]]$Processes[[3]]$DataSource
[1] "Tirona 2003"
[[1]]$Processes[[3]]$Molecule
[1] "OATP1B1"
[[1]]$Processes[[3]]$Parameters
[[1]]$Processes[[3]]$Parameters[[1]]
[[1]]$Processes[[3]]$Parameters[[1]]$Name
[1] "Transporter concentration"
[[1]]$Processes[[3]]$Parameters[[1]]$Value
[1] 109.6
[[1]]$Processes[[3]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[3]]$Parameters[[2]]
[[1]]$Processes[[3]]$Parameters[[2]]$Name
[1] "Vmax"
[[1]]$Processes[[3]]$Parameters[[2]]$Value
[1] 0.372
[[1]]$Processes[[3]]$Parameters[[2]]$Unit
[1] "µmol/l/min"
[[1]]$Processes[[3]]$Parameters[[3]]
[[1]]$Processes[[3]]$Parameters[[3]]$Name
[1] "Km"
[[1]]$Processes[[3]]$Parameters[[3]]$Value
[1] 1.5
[[1]]$Processes[[3]]$Parameters[[3]]$Unit
[1] "µmol/l"
[[1]]$Processes[[3]]$Parameters[[4]]
[[1]]$Processes[[3]]$Parameters[[4]]$Name
[1] "kcat"
[[1]]$Processes[[3]]$Parameters[[4]]$Value
[1] 5.210047
[[1]]$Processes[[3]]$Parameters[[4]]$Unit
[1] "1/min"
[[1]]$Processes[[3]]$Parameters[[4]]$ValueOrigin
[[1]]$Processes[[3]]$Parameters[[4]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[3]]$Parameters[[4]]$ValueOrigin$Method
[1] "ParameterIdentification"
[[1]]$Processes[[3]]$Parameters[[4]]$ValueOrigin$Description
[1] "Hanke et al. 2018"
[[1]]$Processes[[4]]
[[1]]$Processes[[4]]$InternalName
[1] "GlomerularFiltration"
[[1]]$Processes[[4]]$DataSource
[1] "GFR"
[[1]]$Processes[[4]]$Species
[1] "Human"
[[1]]$Processes[[4]]$Parameters
[[1]]$Processes[[4]]$Parameters[[1]]
[[1]]$Processes[[4]]$Parameters[[1]]$Name
[1] "GFR fraction"
[[1]]$Processes[[4]]$Parameters[[1]]$Value
[1] 1
[[1]]$Processes[[4]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[4]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[4]]$Parameters[[1]]$ValueOrigin$Method
[1] "Assumption"
[[1]]$Processes[[4]]$Parameters[[1]]$ValueOrigin$Description
[1] "Hanke et al. 2018"
[[1]]$Processes[[5]]
[[1]]$Processes[[5]]$InternalName
[1] "CompetitiveInhibition"
[[1]]$Processes[[5]]$DataSource
[1] "Kajosaari 2005"
[[1]]$Processes[[5]]$Molecule
[1] "CYP2C8"
[[1]]$Processes[[5]]$Parameters
[[1]]$Processes[[5]]$Parameters[[1]]
[[1]]$Processes[[5]]$Parameters[[1]]$Name
[1] "Ki"
[[1]]$Processes[[5]]$Parameters[[1]]$Value
[1] 30.2
[[1]]$Processes[[5]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[5]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[5]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[5]]$Parameters[[1]]$ValueOrigin$Description
[1] "Kajosaari et al. 2005"
[[1]]$Processes[[6]]
[[1]]$Processes[[6]]$InternalName
[1] "CompetitiveInhibition"
[[1]]$Processes[[6]]$DataSource
[1] "Hanke 2021"
[[1]]$Processes[[6]]$Molecule
[1] "CYP2C9"
[[1]]$Processes[[6]]$Parameters
[[1]]$Processes[[6]]$Parameters[[1]]
[[1]]$Processes[[6]]$Parameters[[1]]$Name
[1] "Ki"
[[1]]$Processes[[6]]$Parameters[[1]]$Value
[1] 150
[[1]]$Processes[[6]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[6]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[6]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[6]]$Parameters[[1]]$ValueOrigin$Description
[1] "Yoshida 2012"
[[1]]$Processes[[7]]
[[1]]$Processes[[7]]$InternalName
[1] "CompetitiveInhibition"
[[1]]$Processes[[7]]$DataSource
[1] "Kajosaari 2005"
[[1]]$Processes[[7]]$Molecule
[1] "CYP3A4"
[[1]]$Processes[[7]]$Parameters
[[1]]$Processes[[7]]$Parameters[[1]]
[[1]]$Processes[[7]]$Parameters[[1]]$Name
[1] "Ki"
[[1]]$Processes[[7]]$Parameters[[1]]$Value
[1] 18.5
[[1]]$Processes[[7]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[7]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[7]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[7]]$Parameters[[1]]$ValueOrigin$Description
[1] "Kajosaari et al. 2005"
[[1]]$Processes[[8]]
[[1]]$Processes[[8]]$InternalName
[1] "CompetitiveInhibition"
[[1]]$Processes[[8]]$DataSource
[1] "Hanke 2021"
[[1]]$Processes[[8]]$Molecule
[1] "BCRP"
[[1]]$Processes[[8]]$Parameters
[[1]]$Processes[[8]]$Parameters[[1]]
[[1]]$Processes[[8]]$Parameters[[1]]$Name
[1] "Ki"
[[1]]$Processes[[8]]$Parameters[[1]]$Value
[1] 14
[[1]]$Processes[[8]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[8]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[8]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[8]]$Parameters[[1]]$ValueOrigin$Description
[1] "Prueksaritanont 2014"
[[1]]$Processes[[9]]
[[1]]$Processes[[9]]$InternalName
[1] "CompetitiveInhibition"
[[1]]$Processes[[9]]$DataSource
[1] "Hanke 2021"
[[1]]$Processes[[9]]$Molecule
[1] "OATP1B1"
[[1]]$Processes[[9]]$Parameters
[[1]]$Processes[[9]]$Parameters[[1]]
[[1]]$Processes[[9]]$Parameters[[1]]$Name
[1] "Ki"
[[1]]$Processes[[9]]$Parameters[[1]]$Value
[1] 0.29
[[1]]$Processes[[9]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[9]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[9]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[9]]$Parameters[[1]]$ValueOrigin$Method
[1] "InVitro"
[[1]]$Processes[[9]]$Parameters[[1]]$ValueOrigin$Description
[1] "Bi 2019"
[[1]]$Processes[[10]]
[[1]]$Processes[[10]]$InternalName
[1] "CompetitiveInhibition"
[[1]]$Processes[[10]]$DataSource
[1] "Hanke 2021"
[[1]]$Processes[[10]]$Molecule
[1] "OATP1B3"
[[1]]$Processes[[10]]$Parameters
[[1]]$Processes[[10]]$Parameters[[1]]
[[1]]$Processes[[10]]$Parameters[[1]]$Name
[1] "Ki"
[[1]]$Processes[[10]]$Parameters[[1]]$Value
[1] 0.5
[[1]]$Processes[[10]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[10]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[10]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[10]]$Parameters[[1]]$ValueOrigin$Method
[1] "InVitro"
[[1]]$Processes[[10]]$Parameters[[1]]$ValueOrigin$Description
[1] "Bi 2019"
[[1]]$Processes[[11]]
[[1]]$Processes[[11]]$InternalName
[1] "CompetitiveInhibition"
[[1]]$Processes[[11]]$DataSource
[1] "Hanke 2021"
[[1]]$Processes[[11]]$Molecule
[1] "OATP2B1"
[[1]]$Processes[[11]]$Parameters
[[1]]$Processes[[11]]$Parameters[[1]]
[[1]]$Processes[[11]]$Parameters[[1]]$Name
[1] "Ki"
[[1]]$Processes[[11]]$Parameters[[1]]$Value
[1] 78.2
[[1]]$Processes[[11]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[11]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[11]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[11]]$Parameters[[1]]$ValueOrigin$Method
[1] "InVitro"
[[1]]$Processes[[11]]$Parameters[[1]]$ValueOrigin$Description
[1] "Zhang 2019"
[[1]]$Processes[[12]]
[[1]]$Processes[[12]]$InternalName
[1] "CompetitiveInhibition"
[[1]]$Processes[[12]]$DataSource
[1] "Hanke 2021"
[[1]]$Processes[[12]]$Molecule
[1] "P-gp"
[[1]]$Processes[[12]]$Parameters
[[1]]$Processes[[12]]$Parameters[[1]]
[[1]]$Processes[[12]]$Parameters[[1]]$Name
[1] "Ki"
[[1]]$Processes[[12]]$Parameters[[1]]$Value
[1] 9.1
[[1]]$Processes[[12]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[12]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[12]]$Parameters[[1]]$ValueOrigin$Source
[1] "Other"
[[1]]$Processes[[12]]$Parameters[[1]]$ValueOrigin$Method
[1] "InVitro"
[[1]]$Processes[[12]]$Parameters[[1]]$ValueOrigin$Description
[1] "NBI"
[[1]]$Processes[[13]]
[[1]]$Processes[[13]]$InternalName
[1] "Induction"
[[1]]$Processes[[13]]$DataSource
[1] "Chen 2010"
[[1]]$Processes[[13]]$Molecule
[1] "CYP1A2"
[[1]]$Processes[[13]]$Parameters
[[1]]$Processes[[13]]$Parameters[[1]]
[[1]]$Processes[[13]]$Parameters[[1]]$Name
[1] "EC50"
[[1]]$Processes[[13]]$Parameters[[1]]$Value
[1] 0.34
[[1]]$Processes[[13]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[13]]$Parameters[[2]]
[[1]]$Processes[[13]]$Parameters[[2]]$Name
[1] "Emax"
[[1]]$Processes[[13]]$Parameters[[2]]$Value
[1] 0.65
[[1]]$Processes[[14]]
[[1]]$Processes[[14]]$InternalName
[1] "Induction"
[[1]]$Processes[[14]]$DataSource
[1] "Buckley 2014"
[[1]]$Processes[[14]]$Molecule
[1] "CYP2C8"
[[1]]$Processes[[14]]$Parameters
[[1]]$Processes[[14]]$Parameters[[1]]
[[1]]$Processes[[14]]$Parameters[[1]]$Name
[1] "EC50"
[[1]]$Processes[[14]]$Parameters[[1]]$Value
[1] 0.34
[[1]]$Processes[[14]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[14]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[14]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[14]]$Parameters[[1]]$ValueOrigin$Description
[1] "Templeton IE, Houston JB, Galetin A. Predictive utility of in vitro rifampin induction data generated in fresh and cryopreserved human hepatocytes, Fa2N-4, and HepaRG cells. Drug Metab Dispos. 2011;39:1921–9; Shou M, Hayashi M, Pan Y, Xu Y, Morrissey K, Xu L, et al. Modeling, prediction, and in vitro in vivo correlation of CYP3A4 induction. Drug Metab Dispos. 2008;36:2355–70. "
[[1]]$Processes[[14]]$Parameters[[2]]
[[1]]$Processes[[14]]$Parameters[[2]]$Name
[1] "Emax"
[[1]]$Processes[[14]]$Parameters[[2]]$Value
[1] 3.2
[[1]]$Processes[[14]]$Parameters[[2]]$ValueOrigin
[[1]]$Processes[[14]]$Parameters[[2]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[14]]$Parameters[[2]]$ValueOrigin$Description
[1] "Buckley DB, Wiegand CM, Prentiss PL, Fahmi OA. Time-course of cytochrome P450 (CYP450) induction in cultured human hepatocytes: Evaluation of activity and mRNA expression profiles for six inducible CYP450 enzymes. ISSX. 2013"
[[1]]$Processes[[15]]
[[1]]$Processes[[15]]$InternalName
[1] "Induction"
[[1]]$Processes[[15]]$DataSource
[1] "Rae 2001"
[[1]]$Processes[[15]]$Molecule
[1] "CYP2E1"
[[1]]$Processes[[15]]$Parameters
[[1]]$Processes[[15]]$Parameters[[1]]
[[1]]$Processes[[15]]$Parameters[[1]]$Name
[1] "EC50"
[[1]]$Processes[[15]]$Parameters[[1]]$Value
[1] 0.34
[[1]]$Processes[[15]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[15]]$Parameters[[2]]
[[1]]$Processes[[15]]$Parameters[[2]]$Name
[1] "Emax"
[[1]]$Processes[[15]]$Parameters[[2]]$Value
[1] 0.8
[[1]]$Processes[[16]]
[[1]]$Processes[[16]]$InternalName
[1] "Induction"
[[1]]$Processes[[16]]$DataSource
[1] "Templeton 2011"
[[1]]$Processes[[16]]$Molecule
[1] "CYP3A4"
[[1]]$Processes[[16]]$Parameters
[[1]]$Processes[[16]]$Parameters[[1]]
[[1]]$Processes[[16]]$Parameters[[1]]$Name
[1] "EC50"
[[1]]$Processes[[16]]$Parameters[[1]]$Value
[1] 0.34
[[1]]$Processes[[16]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[16]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[16]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[16]]$Parameters[[1]]$ValueOrigin$Description
[1] "Templeton 2011 (weighted mean for FHH)"
[[1]]$Processes[[16]]$Parameters[[2]]
[[1]]$Processes[[16]]$Parameters[[2]]$Name
[1] "Emax"
[[1]]$Processes[[16]]$Parameters[[2]]$Value
[1] 9
[[1]]$Processes[[16]]$Parameters[[2]]$ValueOrigin
[[1]]$Processes[[16]]$Parameters[[2]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[16]]$Parameters[[2]]$ValueOrigin$Description
[1] "Templeton 2011 (weighted mean for FHH)"
[[1]]$Processes[[17]]
[[1]]$Processes[[17]]$InternalName
[1] "Induction"
[[1]]$Processes[[17]]$DataSource
[1] "Assumed"
[[1]]$Processes[[17]]$Molecule
[1] "AADAC"
[[1]]$Processes[[17]]$Parameters
[[1]]$Processes[[17]]$Parameters[[1]]
[[1]]$Processes[[17]]$Parameters[[1]]$Name
[1] "EC50"
[[1]]$Processes[[17]]$Parameters[[1]]$Value
[1] 0.34
[[1]]$Processes[[17]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[17]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[17]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[17]]$Parameters[[1]]$ValueOrigin$Method
[1] "Assumption"
[[1]]$Processes[[17]]$Parameters[[1]]$ValueOrigin$Description
[1] "Hanke et al. 2018"
[[1]]$Processes[[17]]$Parameters[[2]]
[[1]]$Processes[[17]]$Parameters[[2]]$Name
[1] "Emax"
[[1]]$Processes[[17]]$Parameters[[2]]$Value
[1] 0.985
[[1]]$Processes[[17]]$Parameters[[2]]$ValueOrigin
[[1]]$Processes[[17]]$Parameters[[2]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[17]]$Parameters[[2]]$ValueOrigin$Method
[1] "ParameterIdentification"
[[1]]$Processes[[17]]$Parameters[[2]]$ValueOrigin$Description
[1] "Hanke et al. 2018"
[[1]]$Processes[[18]]
[[1]]$Processes[[18]]$InternalName
[1] "Induction"
[[1]]$Processes[[18]]$DataSource
[1] "Dixit 2007"
[[1]]$Processes[[18]]$Molecule
[1] "OATP1B1"
[[1]]$Processes[[18]]$Parameters
[[1]]$Processes[[18]]$Parameters[[1]]
[[1]]$Processes[[18]]$Parameters[[1]]$Name
[1] "EC50"
[[1]]$Processes[[18]]$Parameters[[1]]$Value
[1] 0.34
[[1]]$Processes[[18]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[18]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[18]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[18]]$Parameters[[1]]$ValueOrigin$Method
[1] "Assumption"
[[1]]$Processes[[18]]$Parameters[[1]]$ValueOrigin$Description
[1] "Hanke et al. 2018"
[[1]]$Processes[[18]]$Parameters[[2]]
[[1]]$Processes[[18]]$Parameters[[2]]$Name
[1] "Emax"
[[1]]$Processes[[18]]$Parameters[[2]]$Value
[1] 0.383
[[1]]$Processes[[18]]$Parameters[[2]]$ValueOrigin
[[1]]$Processes[[18]]$Parameters[[2]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[18]]$Parameters[[2]]$ValueOrigin$Method
[1] "ParameterIdentification"
[[1]]$Processes[[18]]$Parameters[[2]]$ValueOrigin$Description
[1] "Hanke et al. 2018"
[[1]]$Processes[[19]]
[[1]]$Processes[[19]]$InternalName
[1] "Induction"
[[1]]$Processes[[19]]$DataSource
[1] "Greiner 1999"
[[1]]$Processes[[19]]$Molecule
[1] "P-gp"
[[1]]$Processes[[19]]$Parameters
[[1]]$Processes[[19]]$Parameters[[1]]
[[1]]$Processes[[19]]$Parameters[[1]]$Name
[1] "EC50"
[[1]]$Processes[[19]]$Parameters[[1]]$Value
[1] 0.34
[[1]]$Processes[[19]]$Parameters[[1]]$Unit
[1] "µmol/l"
[[1]]$Processes[[19]]$Parameters[[1]]$ValueOrigin
[[1]]$Processes[[19]]$Parameters[[1]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[19]]$Parameters[[1]]$ValueOrigin$Method
[1] "Assumption"
[[1]]$Processes[[19]]$Parameters[[1]]$ValueOrigin$Description
[1] "Hanke et al. 2018"
[[1]]$Processes[[19]]$Parameters[[2]]
[[1]]$Processes[[19]]$Parameters[[2]]$Name
[1] "Emax"
[[1]]$Processes[[19]]$Parameters[[2]]$Value
[1] 2.5
[[1]]$Processes[[19]]$Parameters[[2]]$ValueOrigin
[[1]]$Processes[[19]]$Parameters[[2]]$ValueOrigin$Source
[1] "Publication"
[[1]]$Processes[[19]]$Parameters[[2]]$ValueOrigin$Method
[1] "Assumption"
[[1]]$Processes[[19]]$Parameters[[2]]$ValueOrigin$Description
[1] "Greiner et al. 1999"
[[1]]$CalculationMethods
[[1]]$CalculationMethods[[1]]
[1] "Cellular partition coefficient method - Rodgers and Rowland"
[[1]]$CalculationMethods[[2]]
[1] "Cellular permeability - PK-Sim Standard"
[[1]]$Parameters
[[1]]$Parameters[[1]]
[[1]]$Parameters[[1]]$Name
[1] "Molecular weight"
[[1]]$Parameters[[1]]$Value
[1] 822.94
[[1]]$Parameters[[1]]$Unit
[1] "g/mol"